{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,11]],"date-time":"2026-09-11T00:36:34Z","timestamp":1789086994114,"version":"build-2803163510"},"reference-count":53,"publisher":"Wiley","issue":"7","license":[{"start":{"date-parts":[[2025,6,4]],"date-time":"2025-06-04T00:00:00Z","timestamp":1748995200000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"content-domain":{"domain":["analyticalsciencejournals.onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Biomedical Chromatography"],"published-print":{"date-parts":[[2025,7]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    The purpose of this work was to use molecular docking techniques to examine the chemical makeup and biological activity of the petroleum ether and chloroform extracts (SPEE and CHSE, respectively) of\n                    <jats:italic>Coffee arabica<\/jats:italic>\n                    seeds. According to the GC\/MS results of SPEE, the extract contains 28 components, which account for approximately 96% of the total. These substances fall under several categories of phytoconstituents. Nevertheless, the extract contains 28 compounds, which make up 99.1% of the total, according to the CHSE GC\/MS data. Alcohols (4.93%) with 2\u2010ethyl\u20101\u2010hexanol as the primary compound, monoterpenes (3.95%) with 4\u2010ethyl\u20101\u2010octyn\u20103\u2010ol accounting for 2.92%, aromatics (2.67%), esters (38.31%) with methyl palmitate as the primary (16.71%), caffeine (28.81%), hydrocarbons (10.85%) with 7\u2010octadecene as the primary compound, and ketones (5.13%) with 2\u2010ethyl\u20101\u2010cyclohexanone as the primary (3.04%) are among them. Only\n                    <jats:styled-content style=\"fixed-case\">\n                      <jats:italic>Bacillus subtilis<\/jats:italic>\n                    <\/jats:styled-content>\n                    was susceptible to the modest antibacterial activity of both extracts. Whereas CHSE successfully targeted breast (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u2009=\u2009146.10\u2009\u03bcg\/mL) and colon cancer cells (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u2009=\u2009111.90\u2009\u03bcg\/mL), SPEE showed strong cytotoxicity against hepatocellular carcinoma (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u2009=\u200942.41\u2009\u03bcg\/mL) and breast cancer cells (IC\n                    <jats:sub>50<\/jats:sub>\n                    \u2009=\u200957.76\u2009\u03bcg\/mL) in anticancer studies.\n                  <\/jats:p>","DOI":"10.1002\/bmc.70132","type":"journal-article","created":{"date-parts":[[2025,6,4]],"date-time":"2025-06-04T20:38:33Z","timestamp":1749069513000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":2,"title":["GC\/MS Analysis of the Chemical Composition of Petroleum Ether and Chloroform Extracts From\n                    <scp>\n                      <i>Coffea arabica<\/i>\n                    <\/scp>\n                    Seeds, Along With Molecular Docking Evaluation of the Extracts Antibacterial and Anticancer Activities"],"prefix":"10.1002","volume":"39","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-4644-1939","authenticated-orcid":false,"given":"Mohsen","family":"Mhamdi","sequence":"first","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"},{"name":"Laboratory for the Application of Materials to the Environment, Water and Energy LAMEER (LAM3E), Faculty of Science Gafsa University of Gafsa  Gafsa Tunisia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Zarah\u00a0I.","family":"Alzahrani","sequence":"additional","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Hassen","family":"Harzali","sequence":"additional","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"},{"name":"Applied Mineral Chemistry Lab. (LR19ES02), Department of Chemistry, Faculty of Sciences of Tunis Tunis El Manar University  Tunis Tunisia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Suliman\u00a0A.","family":"Alderhami","sequence":"additional","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Akram\u00a0A.","family":"Hussain","sequence":"additional","affiliation":[{"name":"Biology Department, Faculty of Science Al\u2010Baha University  Al Aqiq Saudi Arabia"},{"name":"Botany and Microbiology Department, Faculty of Science Zagazig University  Zagazig Egypt"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nashwa\u00a0H.","family":"Abdullah","sequence":"additional","affiliation":[{"name":"Botany and Microbiology Department, Faculty of Science Helwan University  Cairo Egypt"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-2893-0376","authenticated-orcid":false,"given":"Ahmed\u00a0A.","family":"Elhenawy","sequence":"additional","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"},{"name":"Chemistry Department, Faculty of Science Al\u2010Azhar University  Cairo Egypt"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Khaled\u00a0A.","family":"Abdelshafeek","sequence":"additional","affiliation":[{"name":"Faculty of Sciences, Department of Chemistry Al\u2010Baha University  Al Aqiq Saudi Arabia"},{"name":"Pharmaceutical Industries and Drugs Institute, Chemistry of Medicinal Plants Department National Research Center  Giza Egypt"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2025,6,4]]},"reference":[{"issue":"8","key":"e_1_2_6_2_1","first-page":"763","article-title":"GC\/MS Analysis of the Oils and Lipid Constituents and Evaluation of Different Extracts From \n                     Salvia fruticosa\n                   Mill. 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